USER MOD reduce.3.24.130724 H: found=0, std=0, add=539, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 531 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 194 LYS NZ :NH3+ 161:sc= 0.0225 (180deg=-0.0117) USER MOD Set 1.2: A 198 MET CE :methyl -116:sc= -0.42 (180deg=-0.934) USER MOD Set 2.1: A 189 TYR OH : rot -58:sc= 1.15 USER MOD Set 2.2: A 193 GLN : amide:sc= 0.863 K(o=2,f=-0.47) USER MOD Set 3.1: A 171 CYS SG : rot 144:sc= 0.858 USER MOD Set 3.2: A 177 CYS SG : rot 148:sc= 0.418 USER MOD Set 3.3: A 187 CYS SG : rot 171:sc= 0.191 USER MOD Set 3.4: A 190 CYS SG : rot 120:sc= -1.59 USER MOD Set 4.1: A 162 THR OG1 : rot 82:sc= 1.95 USER MOD Set 4.2: A 169 TYR OH : rot 171:sc= 1.06 USER MOD Set 5.1: A 146 HIS : no HE2:sc= -0.309 K(o=-0.075,f=-6!) USER MOD Set 5.2: A 156 LYS NZ :NH3+ 151:sc= 0.234 (180deg=-0.00193) USER MOD Set 6.1: A 145 LYS NZ :NH3+ -176:sc= 0.395 (180deg=0.0141) USER MOD Set 6.2: A 150 TYR OH : rot 180:sc= 0.304 USER MOD Set 7.1: A 135 CYS SG : rot 26:sc= 0.594 USER MOD Set 7.2: A 138 CYS SG : rot -34:sc= 0.51 USER MOD Set 7.3: A 151 SER OG : rot 31:sc= 1.38 USER MOD Set 7.4: A 152 CYS SG : rot -68:sc= 0.37 USER MOD Set 7.5: A 155 CYS SG : rot 160:sc= 0.251 USER MOD Set 7.6: A 200 MET CE :methyl -176:sc= -0.115 (180deg=-0.119) USER MOD Single : A 133 HIS : no HD1:sc= -0.683 X(o=-0.68,f=-1) USER MOD Single : A 142 SER OG : rot 29:sc= 1.15 USER MOD Single : A 143 SER OG : rot -90:sc= 0.542 USER MOD Single : A 147 TYR OH : rot -149:sc= 1.11 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0452) USER MOD Single : A 168 THR OG1 : rot 53:sc= 0.368 USER MOD Single : A 170 THR OG1 : rot 180:sc= -0.176 USER MOD Single : A 174 ASN : amide:sc= 0.751 K(o=0.75,f=0) USER MOD Single : A 175 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0117) USER MOD Single : A 188 GLN : amide:sc= 0.81 K(o=0.81,f=-5.9!) USER MOD Single : A 192 TYR OH : rot 150:sc= 2.54 USER MOD Single : A 201 LYS NZ :NH3+ -155:sc= 0.999 (180deg=0.366) USER MOD Single : A 206 GLN : amide:sc= 0.407 K(o=0.41,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 57 N HIS A 133 -2.705 -5.163 15.530 1.00 0.00 N ATOM 58 CA HIS A 133 -2.968 -4.172 14.503 1.00 0.00 C ATOM 59 C HIS A 133 -3.337 -4.828 13.170 1.00 0.00 C ATOM 60 O HIS A 133 -2.764 -5.847 12.769 1.00 0.00 O ATOM 61 CB HIS A 133 -1.747 -3.264 14.304 1.00 0.00 C ATOM 62 CG HIS A 133 -1.452 -2.350 15.466 1.00 0.00 C ATOM 63 ND1 HIS A 133 -0.684 -2.658 16.565 1.00 0.00 N ATOM 64 CD2 HIS A 133 -1.821 -1.035 15.577 1.00 0.00 C ATOM 65 CE1 HIS A 133 -0.599 -1.550 17.321 1.00 0.00 C ATOM 66 NE2 HIS A 133 -1.266 -0.530 16.757 1.00 0.00 N ATOM 0 HA HIS A 133 -3.815 -3.574 14.840 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.873 -3.888 14.118 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -1.902 -2.658 13.412 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -2.433 -0.486 14.877 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.065 -1.488 18.258 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -1.351 0.421 17.117 1.00 0.00 H new ATOM 74 N ILE A 134 -4.266 -4.189 12.462 1.00 0.00 N ATOM 75 CA ILE A 134 -4.678 -4.564 11.121 1.00 0.00 C ATOM 76 C ILE A 134 -3.984 -3.620 10.145 1.00 0.00 C ATOM 77 O ILE A 134 -3.569 -2.520 10.511 1.00 0.00 O ATOM 78 CB ILE A 134 -6.206 -4.516 10.959 1.00 0.00 C ATOM 79 CG1 ILE A 134 -6.826 -3.248 11.574 1.00 0.00 C ATOM 80 CG2 ILE A 134 -6.824 -5.798 11.522 1.00 0.00 C ATOM 81 CD1 ILE A 134 -8.278 -3.038 11.135 1.00 0.00 C ATOM 0 H ILE A 134 -4.764 -3.374 12.820 1.00 0.00 H new ATOM 0 HA ILE A 134 -4.388 -5.595 10.919 1.00 0.00 H new ATOM 0 HB ILE A 134 -6.435 -4.461 9.895 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -6.784 -3.316 12.661 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -6.233 -2.380 11.286 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -7.907 -5.761 11.406 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -6.430 -6.659 10.982 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -6.575 -5.888 12.579 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.670 -2.131 11.596 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -8.320 -2.941 10.050 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -8.879 -3.892 11.446 1.00 0.00 H new ATOM 93 N CYS A 135 -3.835 -4.064 8.902 1.00 0.00 N ATOM 94 CA CYS A 135 -3.185 -3.306 7.860 1.00 0.00 C ATOM 95 C CYS A 135 -4.078 -2.147 7.445 1.00 0.00 C ATOM 96 O CYS A 135 -5.205 -2.376 7.018 1.00 0.00 O ATOM 97 CB CYS A 135 -2.913 -4.220 6.661 1.00 0.00 C ATOM 98 SG CYS A 135 -2.141 -3.376 5.258 1.00 0.00 S ATOM 0 H CYS A 135 -4.171 -4.976 8.594 1.00 0.00 H new ATOM 0 HA CYS A 135 -2.238 -2.910 8.227 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -2.268 -5.039 6.980 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -3.853 -4.663 6.333 1.00 0.00 H new ATOM 0 HG CYS A 135 -1.486 -2.337 5.684 1.00 0.00 H new ATOM 103 N ALA A 136 -3.583 -0.914 7.533 1.00 0.00 N ATOM 104 CA ALA A 136 -4.357 0.258 7.143 1.00 0.00 C ATOM 105 C ALA A 136 -4.960 0.127 5.739 1.00 0.00 C ATOM 106 O ALA A 136 -6.081 0.563 5.490 1.00 0.00 O ATOM 107 CB ALA A 136 -3.452 1.487 7.224 1.00 0.00 C ATOM 0 H ALA A 136 -2.645 -0.702 7.873 1.00 0.00 H new ATOM 0 HA ALA A 136 -5.198 0.356 7.829 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -4.016 2.374 6.935 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -3.089 1.605 8.245 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.605 1.360 6.550 1.00 0.00 H new ATOM 113 N ILE A 137 -4.189 -0.435 4.808 1.00 0.00 N ATOM 114 CA ILE A 137 -4.560 -0.536 3.402 1.00 0.00 C ATOM 115 C ILE A 137 -5.600 -1.628 3.105 1.00 0.00 C ATOM 116 O ILE A 137 -6.451 -1.402 2.246 1.00 0.00 O ATOM 117 CB ILE A 137 -3.283 -0.685 2.552 1.00 0.00 C ATOM 118 CG1 ILE A 137 -2.387 0.560 2.713 1.00 0.00 C ATOM 119 CG2 ILE A 137 -3.611 -0.867 1.060 1.00 0.00 C ATOM 120 CD1 ILE A 137 -0.916 0.237 2.450 1.00 0.00 C ATOM 0 H ILE A 137 -3.275 -0.838 5.016 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.069 0.388 3.127 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.762 -1.574 2.907 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -2.717 1.337 2.024 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.497 0.959 3.721 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -2.685 -0.969 0.494 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.218 -1.763 0.927 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.163 0.001 0.700 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -0.318 1.140 2.573 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -0.578 -0.522 3.156 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -0.802 -0.138 1.433 1.00 0.00 H new ATOM 132 N CYS A 138 -5.527 -2.807 3.742 1.00 0.00 N ATOM 133 CA CYS A 138 -6.420 -3.929 3.407 1.00 0.00 C ATOM 134 C CYS A 138 -7.028 -4.683 4.593 1.00 0.00 C ATOM 135 O CYS A 138 -7.735 -5.667 4.397 1.00 0.00 O ATOM 136 CB CYS A 138 -5.692 -4.882 2.453 1.00 0.00 C ATOM 137 SG CYS A 138 -4.148 -5.612 3.060 1.00 0.00 S ATOM 0 H CYS A 138 -4.862 -3.008 4.489 1.00 0.00 H new ATOM 0 HA CYS A 138 -7.289 -3.481 2.925 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -6.374 -5.692 2.194 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -5.475 -4.342 1.531 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.538 -4.760 3.829 1.00 0.00 H new ATOM 142 N GLY A 139 -6.793 -4.239 5.825 1.00 0.00 N ATOM 143 CA GLY A 139 -7.389 -4.827 7.015 1.00 0.00 C ATOM 144 C GLY A 139 -6.857 -6.211 7.400 1.00 0.00 C ATOM 145 O GLY A 139 -7.355 -6.803 8.355 1.00 0.00 O ATOM 0 H GLY A 139 -6.176 -3.452 6.024 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -7.230 -4.149 7.853 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.466 -4.899 6.864 1.00 0.00 H new ATOM 149 N ASP A 140 -5.853 -6.744 6.697 1.00 0.00 N ATOM 150 CA ASP A 140 -5.268 -8.038 7.032 1.00 0.00 C ATOM 151 C ASP A 140 -4.357 -7.876 8.247 1.00 0.00 C ATOM 152 O ASP A 140 -4.075 -6.755 8.658 1.00 0.00 O ATOM 153 CB ASP A 140 -4.494 -8.576 5.825 1.00 0.00 C ATOM 154 CG ASP A 140 -5.448 -9.048 4.736 1.00 0.00 C ATOM 155 OD1 ASP A 140 -5.858 -8.184 3.933 1.00 0.00 O ATOM 156 OD2 ASP A 140 -5.761 -10.258 4.739 1.00 0.00 O ATOM 0 H ASP A 140 -5.429 -6.292 5.887 1.00 0.00 H new ATOM 0 HA ASP A 140 -6.051 -8.755 7.280 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.841 -7.798 5.430 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -3.854 -9.401 6.137 1.00 0.00 H new ATOM 161 N ARG A 141 -3.879 -8.979 8.827 1.00 0.00 N ATOM 162 CA ARG A 141 -2.989 -8.920 9.980 1.00 0.00 C ATOM 163 C ARG A 141 -1.752 -8.081 9.644 1.00 0.00 C ATOM 164 O ARG A 141 -1.018 -8.421 8.717 1.00 0.00 O ATOM 165 CB ARG A 141 -2.591 -10.346 10.383 1.00 0.00 C ATOM 166 CG ARG A 141 -1.596 -10.404 11.552 1.00 0.00 C ATOM 167 CD ARG A 141 -2.086 -9.650 12.792 1.00 0.00 C ATOM 168 NE ARG A 141 -3.445 -10.067 13.168 1.00 0.00 N ATOM 169 CZ ARG A 141 -4.443 -9.266 13.572 1.00 0.00 C ATOM 170 NH1 ARG A 141 -4.313 -7.936 13.580 1.00 0.00 N ATOM 171 NH2 ARG A 141 -5.590 -9.813 13.986 1.00 0.00 N ATOM 0 H ARG A 141 -4.096 -9.925 8.513 1.00 0.00 H new ATOM 0 HA ARG A 141 -3.501 -8.447 10.818 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -3.489 -10.901 10.654 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -2.154 -10.849 9.520 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -1.414 -11.446 11.815 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -0.642 -9.985 11.232 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -1.405 -9.831 13.623 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -2.073 -8.578 12.597 1.00 0.00 H new ATOM 0 HE ARG A 141 -3.650 -11.065 13.117 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -3.440 -7.507 13.274 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -5.087 -7.350 13.892 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -5.698 -10.827 13.992 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -6.357 -9.216 14.296 1.00 0.00 H new ATOM 185 N SER A 142 -1.506 -6.995 10.386 1.00 0.00 N ATOM 186 CA SER A 142 -0.326 -6.180 10.150 1.00 0.00 C ATOM 187 C SER A 142 0.922 -6.986 10.504 1.00 0.00 C ATOM 188 O SER A 142 0.956 -7.673 11.523 1.00 0.00 O ATOM 189 CB SER A 142 -0.387 -4.897 10.990 1.00 0.00 C ATOM 190 OG SER A 142 0.761 -4.091 10.803 1.00 0.00 O ATOM 0 H SER A 142 -2.105 -6.669 11.145 1.00 0.00 H new ATOM 0 HA SER A 142 -0.287 -5.898 9.098 1.00 0.00 H new ATOM 0 HB2 SER A 142 -1.278 -4.329 10.721 1.00 0.00 H new ATOM 0 HB3 SER A 142 -0.481 -5.157 12.044 1.00 0.00 H new ATOM 0 HG SER A 142 1.125 -4.243 9.906 1.00 0.00 H new ATOM 196 N SER A 143 1.958 -6.850 9.679 1.00 0.00 N ATOM 197 CA SER A 143 3.266 -7.428 9.915 1.00 0.00 C ATOM 198 C SER A 143 4.030 -6.471 10.829 1.00 0.00 C ATOM 199 O SER A 143 4.804 -6.912 11.674 1.00 0.00 O ATOM 200 CB SER A 143 3.995 -7.649 8.587 1.00 0.00 C ATOM 201 OG SER A 143 3.192 -8.436 7.725 1.00 0.00 O ATOM 0 H SER A 143 1.903 -6.321 8.809 1.00 0.00 H new ATOM 0 HA SER A 143 3.184 -8.404 10.394 1.00 0.00 H new ATOM 0 HB2 SER A 143 4.216 -6.690 8.119 1.00 0.00 H new ATOM 0 HB3 SER A 143 4.950 -8.145 8.763 1.00 0.00 H new ATOM 0 HG SER A 143 3.395 -9.385 7.865 1.00 0.00 H new ATOM 207 N GLY A 144 3.805 -5.160 10.676 1.00 0.00 N ATOM 208 CA GLY A 144 4.433 -4.172 11.528 1.00 0.00 C ATOM 209 C GLY A 144 4.184 -2.755 11.025 1.00 0.00 C ATOM 210 O GLY A 144 3.418 -2.527 10.086 1.00 0.00 O ATOM 0 H GLY A 144 3.188 -4.769 9.964 1.00 0.00 H new ATOM 0 HA2 GLY A 144 4.049 -4.270 12.544 1.00 0.00 H new ATOM 0 HA3 GLY A 144 5.506 -4.359 11.573 1.00 0.00 H new ATOM 214 N LYS A 145 4.875 -1.809 11.663 1.00 0.00 N ATOM 215 CA LYS A 145 4.854 -0.398 11.330 1.00 0.00 C ATOM 216 C LYS A 145 5.689 -0.236 10.057 1.00 0.00 C ATOM 217 O LYS A 145 6.860 -0.619 10.041 1.00 0.00 O ATOM 218 CB LYS A 145 5.444 0.375 12.523 1.00 0.00 C ATOM 219 CG LYS A 145 5.134 1.876 12.537 1.00 0.00 C ATOM 220 CD LYS A 145 3.626 2.129 12.673 1.00 0.00 C ATOM 221 CE LYS A 145 3.318 3.448 13.392 1.00 0.00 C ATOM 222 NZ LYS A 145 3.605 3.364 14.836 1.00 0.00 N ATOM 0 H LYS A 145 5.484 -2.020 12.453 1.00 0.00 H new ATOM 0 HA LYS A 145 3.852 -0.010 11.146 1.00 0.00 H new ATOM 0 HB2 LYS A 145 5.068 -0.067 13.445 1.00 0.00 H new ATOM 0 HB3 LYS A 145 6.526 0.242 12.524 1.00 0.00 H new ATOM 0 HG2 LYS A 145 5.661 2.351 13.364 1.00 0.00 H new ATOM 0 HG3 LYS A 145 5.501 2.335 11.619 1.00 0.00 H new ATOM 0 HD2 LYS A 145 3.172 2.144 11.682 1.00 0.00 H new ATOM 0 HD3 LYS A 145 3.170 1.304 13.221 1.00 0.00 H new ATOM 0 HE2 LYS A 145 3.909 4.250 12.950 1.00 0.00 H new ATOM 0 HE3 LYS A 145 2.269 3.706 13.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 3.321 4.251 15.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 3.073 2.572 15.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 4.623 3.210 14.979 1.00 0.00 H new ATOM 236 N HIS A 146 5.095 0.261 8.972 1.00 0.00 N ATOM 237 CA HIS A 146 5.746 0.420 7.679 1.00 0.00 C ATOM 238 C HIS A 146 5.440 1.833 7.195 1.00 0.00 C ATOM 239 O HIS A 146 4.285 2.248 7.215 1.00 0.00 O ATOM 240 CB HIS A 146 5.207 -0.631 6.700 1.00 0.00 C ATOM 241 CG HIS A 146 5.305 -2.058 7.191 1.00 0.00 C ATOM 242 ND1 HIS A 146 6.168 -2.541 8.149 1.00 0.00 N ATOM 243 CD2 HIS A 146 4.523 -3.105 6.782 1.00 0.00 C ATOM 244 CE1 HIS A 146 5.914 -3.851 8.303 1.00 0.00 C ATOM 245 NE2 HIS A 146 4.928 -4.245 7.481 1.00 0.00 N ATOM 0 H HIS A 146 4.123 0.571 8.972 1.00 0.00 H new ATOM 0 HA HIS A 146 6.824 0.277 7.752 1.00 0.00 H new ATOM 0 HB2 HIS A 146 4.163 -0.406 6.485 1.00 0.00 H new ATOM 0 HB3 HIS A 146 5.752 -0.546 5.760 1.00 0.00 H new ATOM 0 HD1 HIS A 146 6.873 -2.001 8.651 1.00 0.00 H new ATOM 0 HD2 HIS A 146 3.732 -3.058 6.048 1.00 0.00 H new ATOM 0 HE1 HIS A 146 6.432 -4.499 8.994 1.00 0.00 H new ATOM 253 N TYR A 147 6.466 2.590 6.798 1.00 0.00 N ATOM 254 CA TYR A 147 6.325 3.973 6.341 1.00 0.00 C ATOM 255 C TYR A 147 5.439 4.820 7.273 1.00 0.00 C ATOM 256 O TYR A 147 4.725 5.712 6.817 1.00 0.00 O ATOM 257 CB TYR A 147 5.838 4.020 4.883 1.00 0.00 C ATOM 258 CG TYR A 147 6.313 2.874 4.014 1.00 0.00 C ATOM 259 CD1 TYR A 147 7.666 2.777 3.650 1.00 0.00 C ATOM 260 CD2 TYR A 147 5.434 1.816 3.719 1.00 0.00 C ATOM 261 CE1 TYR A 147 8.156 1.590 3.086 1.00 0.00 C ATOM 262 CE2 TYR A 147 5.917 0.647 3.114 1.00 0.00 C ATOM 263 CZ TYR A 147 7.287 0.518 2.842 1.00 0.00 C ATOM 264 OH TYR A 147 7.781 -0.638 2.331 1.00 0.00 O ATOM 0 H TYR A 147 7.429 2.255 6.785 1.00 0.00 H new ATOM 0 HA TYR A 147 7.315 4.427 6.379 1.00 0.00 H new ATOM 0 HB2 TYR A 147 4.748 4.032 4.880 1.00 0.00 H new ATOM 0 HB3 TYR A 147 6.168 4.957 4.435 1.00 0.00 H new ATOM 0 HD1 TYR A 147 8.329 3.616 3.804 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.385 1.904 3.959 1.00 0.00 H new ATOM 0 HE1 TYR A 147 9.204 1.502 2.840 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.236 -0.152 2.858 1.00 0.00 H new ATOM 0 HH TYR A 147 7.095 -1.073 1.783 1.00 0.00 H new ATOM 274 N GLY A 148 5.501 4.545 8.582 1.00 0.00 N ATOM 275 CA GLY A 148 4.762 5.271 9.606 1.00 0.00 C ATOM 276 C GLY A 148 3.362 4.730 9.925 1.00 0.00 C ATOM 277 O GLY A 148 2.723 5.275 10.822 1.00 0.00 O ATOM 0 H GLY A 148 6.080 3.795 8.960 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.350 5.268 10.524 1.00 0.00 H new ATOM 0 HA3 GLY A 148 4.667 6.310 9.291 1.00 0.00 H new ATOM 281 N VAL A 149 2.866 3.687 9.245 1.00 0.00 N ATOM 282 CA VAL A 149 1.528 3.141 9.492 1.00 0.00 C ATOM 283 C VAL A 149 1.570 1.610 9.548 1.00 0.00 C ATOM 284 O VAL A 149 2.385 0.974 8.886 1.00 0.00 O ATOM 285 CB VAL A 149 0.563 3.663 8.411 1.00 0.00 C ATOM 286 CG1 VAL A 149 -0.722 2.842 8.295 1.00 0.00 C ATOM 287 CG2 VAL A 149 0.213 5.140 8.638 1.00 0.00 C ATOM 0 H VAL A 149 3.381 3.201 8.511 1.00 0.00 H new ATOM 0 HA VAL A 149 1.163 3.476 10.463 1.00 0.00 H new ATOM 0 HB VAL A 149 1.101 3.558 7.469 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -1.355 3.265 7.515 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -0.474 1.811 8.041 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -1.254 2.863 9.246 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -0.470 5.476 7.858 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -0.264 5.256 9.611 1.00 0.00 H new ATOM 0 HG23 VAL A 149 1.123 5.739 8.606 1.00 0.00 H new ATOM 297 N TYR A 150 0.690 1.006 10.350 1.00 0.00 N ATOM 298 CA TYR A 150 0.607 -0.442 10.489 1.00 0.00 C ATOM 299 C TYR A 150 0.166 -1.061 9.162 1.00 0.00 C ATOM 300 O TYR A 150 -0.866 -0.682 8.598 1.00 0.00 O ATOM 301 CB TYR A 150 -0.341 -0.807 11.635 1.00 0.00 C ATOM 302 CG TYR A 150 0.150 -0.314 12.982 1.00 0.00 C ATOM 303 CD1 TYR A 150 1.094 -1.065 13.708 1.00 0.00 C ATOM 304 CD2 TYR A 150 -0.249 0.950 13.456 1.00 0.00 C ATOM 305 CE1 TYR A 150 1.688 -0.523 14.861 1.00 0.00 C ATOM 306 CE2 TYR A 150 0.330 1.482 14.620 1.00 0.00 C ATOM 307 CZ TYR A 150 1.295 0.744 15.325 1.00 0.00 C ATOM 308 OH TYR A 150 1.910 1.288 16.411 1.00 0.00 O ATOM 0 H TYR A 150 0.014 1.513 10.922 1.00 0.00 H new ATOM 0 HA TYR A 150 1.588 -0.847 10.737 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -1.325 -0.384 11.435 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -0.461 -1.890 11.671 1.00 0.00 H new ATOM 0 HD1 TYR A 150 1.362 -2.058 13.379 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -1.002 1.512 12.924 1.00 0.00 H new ATOM 0 HE1 TYR A 150 2.447 -1.080 15.390 1.00 0.00 H new ATOM 0 HE2 TYR A 150 0.033 2.459 14.973 1.00 0.00 H new ATOM 0 HH TYR A 150 1.522 2.168 16.600 1.00 0.00 H new ATOM 318 N SER A 151 0.959 -1.995 8.633 1.00 0.00 N ATOM 319 CA SER A 151 0.672 -2.646 7.366 1.00 0.00 C ATOM 320 C SER A 151 1.268 -4.053 7.323 1.00 0.00 C ATOM 321 O SER A 151 1.896 -4.478 8.295 1.00 0.00 O ATOM 322 CB SER A 151 1.043 -1.705 6.213 1.00 0.00 C ATOM 323 OG SER A 151 -0.072 -0.871 5.955 1.00 0.00 O ATOM 0 H SER A 151 1.819 -2.318 9.077 1.00 0.00 H new ATOM 0 HA SER A 151 -0.396 -2.828 7.247 1.00 0.00 H new ATOM 0 HB2 SER A 151 1.915 -1.106 6.475 1.00 0.00 H new ATOM 0 HB3 SER A 151 1.305 -2.277 5.323 1.00 0.00 H new ATOM 0 HG SER A 151 -0.566 -0.719 6.787 1.00 0.00 H new ATOM 329 N CYS A 152 0.995 -4.799 6.246 1.00 0.00 N ATOM 330 CA CYS A 152 1.404 -6.190 6.073 1.00 0.00 C ATOM 331 C CYS A 152 2.486 -6.329 5.002 1.00 0.00 C ATOM 332 O CYS A 152 2.560 -5.500 4.098 1.00 0.00 O ATOM 333 CB CYS A 152 0.185 -7.067 5.757 1.00 0.00 C ATOM 334 SG CYS A 152 -0.721 -6.689 4.232 1.00 0.00 S ATOM 0 H CYS A 152 0.468 -4.438 5.451 1.00 0.00 H new ATOM 0 HA CYS A 152 1.840 -6.535 7.010 1.00 0.00 H new ATOM 0 HB2 CYS A 152 0.516 -8.104 5.707 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -0.511 -6.995 6.593 1.00 0.00 H new ATOM 0 HG CYS A 152 -1.319 -5.542 4.356 1.00 0.00 H new ATOM 339 N GLU A 153 3.317 -7.371 5.110 1.00 0.00 N ATOM 340 CA GLU A 153 4.428 -7.673 4.209 1.00 0.00 C ATOM 341 C GLU A 153 4.134 -7.427 2.716 1.00 0.00 C ATOM 342 O GLU A 153 4.957 -6.837 2.016 1.00 0.00 O ATOM 343 CB GLU A 153 4.998 -9.080 4.483 1.00 0.00 C ATOM 344 CG GLU A 153 3.996 -10.203 4.817 1.00 0.00 C ATOM 345 CD GLU A 153 2.973 -10.463 3.721 1.00 0.00 C ATOM 346 OE1 GLU A 153 3.308 -11.231 2.795 1.00 0.00 O ATOM 347 OE2 GLU A 153 1.882 -9.854 3.811 1.00 0.00 O ATOM 0 H GLU A 153 3.227 -8.055 5.861 1.00 0.00 H new ATOM 0 HA GLU A 153 5.204 -6.944 4.442 1.00 0.00 H new ATOM 0 HB2 GLU A 153 5.568 -9.388 3.607 1.00 0.00 H new ATOM 0 HB3 GLU A 153 5.703 -9.002 5.311 1.00 0.00 H new ATOM 0 HG2 GLU A 153 4.548 -11.123 5.011 1.00 0.00 H new ATOM 0 HG3 GLU A 153 3.471 -9.946 5.737 1.00 0.00 H new ATOM 354 N GLY A 154 2.977 -7.870 2.221 1.00 0.00 N ATOM 355 CA GLY A 154 2.601 -7.694 0.825 1.00 0.00 C ATOM 356 C GLY A 154 2.575 -6.208 0.485 1.00 0.00 C ATOM 357 O GLY A 154 3.290 -5.749 -0.405 1.00 0.00 O ATOM 0 H GLY A 154 2.278 -8.360 2.779 1.00 0.00 H new ATOM 0 HA2 GLY A 154 3.309 -8.213 0.179 1.00 0.00 H new ATOM 0 HA3 GLY A 154 1.621 -8.136 0.643 1.00 0.00 H new ATOM 361 N CYS A 155 1.776 -5.453 1.244 1.00 0.00 N ATOM 362 CA CYS A 155 1.657 -4.011 1.116 1.00 0.00 C ATOM 363 C CYS A 155 3.023 -3.344 1.297 1.00 0.00 C ATOM 364 O CYS A 155 3.350 -2.414 0.566 1.00 0.00 O ATOM 365 CB CYS A 155 0.636 -3.493 2.127 1.00 0.00 C ATOM 366 SG CYS A 155 -1.073 -3.931 1.715 1.00 0.00 S ATOM 0 H CYS A 155 1.184 -5.842 1.978 1.00 0.00 H new ATOM 0 HA CYS A 155 1.305 -3.760 0.116 1.00 0.00 H new ATOM 0 HB2 CYS A 155 0.878 -3.891 3.112 1.00 0.00 H new ATOM 0 HB3 CYS A 155 0.719 -2.408 2.193 1.00 0.00 H new ATOM 0 HG CYS A 155 -1.811 -3.851 2.782 1.00 0.00 H new ATOM 371 N LYS A 156 3.817 -3.827 2.256 1.00 0.00 N ATOM 372 CA LYS A 156 5.158 -3.332 2.524 1.00 0.00 C ATOM 373 C LYS A 156 5.991 -3.368 1.241 1.00 0.00 C ATOM 374 O LYS A 156 6.360 -2.316 0.716 1.00 0.00 O ATOM 375 CB LYS A 156 5.827 -4.139 3.644 1.00 0.00 C ATOM 376 CG LYS A 156 7.127 -3.492 4.143 1.00 0.00 C ATOM 377 CD LYS A 156 7.812 -4.479 5.094 1.00 0.00 C ATOM 378 CE LYS A 156 9.161 -3.973 5.617 1.00 0.00 C ATOM 379 NZ LYS A 156 9.017 -2.771 6.456 1.00 0.00 N ATOM 0 H LYS A 156 3.535 -4.587 2.876 1.00 0.00 H new ATOM 0 HA LYS A 156 5.090 -2.299 2.864 1.00 0.00 H new ATOM 0 HB2 LYS A 156 5.133 -4.240 4.478 1.00 0.00 H new ATOM 0 HB3 LYS A 156 6.041 -5.145 3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 156 7.781 -3.255 3.304 1.00 0.00 H new ATOM 0 HG3 LYS A 156 6.914 -2.554 4.656 1.00 0.00 H new ATOM 0 HD2 LYS A 156 7.153 -4.677 5.939 1.00 0.00 H new ATOM 0 HD3 LYS A 156 7.962 -5.427 4.578 1.00 0.00 H new ATOM 0 HE2 LYS A 156 9.644 -4.761 6.195 1.00 0.00 H new ATOM 0 HE3 LYS A 156 9.815 -3.749 4.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 9.786 -2.742 7.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 9.062 -1.922 5.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 8.102 -2.799 6.949 1.00 0.00 H new ATOM 393 N GLY A 157 6.284 -4.576 0.748 1.00 0.00 N ATOM 394 CA GLY A 157 7.096 -4.778 -0.444 1.00 0.00 C ATOM 395 C GLY A 157 6.505 -4.031 -1.634 1.00 0.00 C ATOM 396 O GLY A 157 7.213 -3.338 -2.367 1.00 0.00 O ATOM 0 H GLY A 157 5.959 -5.444 1.173 1.00 0.00 H new ATOM 0 HA2 GLY A 157 8.113 -4.431 -0.260 1.00 0.00 H new ATOM 0 HA3 GLY A 157 7.158 -5.842 -0.671 1.00 0.00 H new ATOM 400 N PHE A 158 5.190 -4.177 -1.816 1.00 0.00 N ATOM 401 CA PHE A 158 4.446 -3.516 -2.873 1.00 0.00 C ATOM 402 C PHE A 158 4.734 -2.018 -2.880 1.00 0.00 C ATOM 403 O PHE A 158 5.172 -1.488 -3.897 1.00 0.00 O ATOM 404 CB PHE A 158 2.952 -3.772 -2.670 1.00 0.00 C ATOM 405 CG PHE A 158 2.056 -2.783 -3.379 1.00 0.00 C ATOM 406 CD1 PHE A 158 1.959 -2.803 -4.780 1.00 0.00 C ATOM 407 CD2 PHE A 158 1.349 -1.818 -2.634 1.00 0.00 C ATOM 408 CE1 PHE A 158 1.055 -1.946 -5.422 1.00 0.00 C ATOM 409 CE2 PHE A 158 0.508 -0.907 -3.290 1.00 0.00 C ATOM 410 CZ PHE A 158 0.341 -0.994 -4.681 1.00 0.00 C ATOM 0 H PHE A 158 4.610 -4.768 -1.220 1.00 0.00 H new ATOM 0 HA PHE A 158 4.756 -3.920 -3.837 1.00 0.00 H new ATOM 0 HB2 PHE A 158 2.715 -4.777 -3.020 1.00 0.00 H new ATOM 0 HB3 PHE A 158 2.731 -3.746 -1.603 1.00 0.00 H new ATOM 0 HD1 PHE A 158 2.577 -3.474 -5.358 1.00 0.00 H new ATOM 0 HD2 PHE A 158 1.455 -1.780 -1.560 1.00 0.00 H new ATOM 0 HE1 PHE A 158 0.908 -2.019 -6.489 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -0.008 -0.143 -2.728 1.00 0.00 H new ATOM 0 HZ PHE A 158 -0.341 -0.324 -5.183 1.00 0.00 H new ATOM 420 N PHE A 159 4.478 -1.338 -1.762 1.00 0.00 N ATOM 421 CA PHE A 159 4.679 0.097 -1.658 1.00 0.00 C ATOM 422 C PHE A 159 6.146 0.430 -1.902 1.00 0.00 C ATOM 423 O PHE A 159 6.446 1.326 -2.683 1.00 0.00 O ATOM 424 CB PHE A 159 4.210 0.614 -0.295 1.00 0.00 C ATOM 425 CG PHE A 159 4.216 2.128 -0.179 1.00 0.00 C ATOM 426 CD1 PHE A 159 3.164 2.876 -0.740 1.00 0.00 C ATOM 427 CD2 PHE A 159 5.263 2.796 0.485 1.00 0.00 C ATOM 428 CE1 PHE A 159 3.127 4.274 -0.583 1.00 0.00 C ATOM 429 CE2 PHE A 159 5.182 4.179 0.716 1.00 0.00 C ATOM 430 CZ PHE A 159 4.123 4.923 0.166 1.00 0.00 C ATOM 0 H PHE A 159 4.126 -1.771 -0.908 1.00 0.00 H new ATOM 0 HA PHE A 159 4.080 0.596 -2.419 1.00 0.00 H new ATOM 0 HB2 PHE A 159 3.201 0.248 -0.106 1.00 0.00 H new ATOM 0 HB3 PHE A 159 4.851 0.197 0.482 1.00 0.00 H new ATOM 0 HD1 PHE A 159 2.383 2.376 -1.293 1.00 0.00 H new ATOM 0 HD2 PHE A 159 6.130 2.244 0.817 1.00 0.00 H new ATOM 0 HE1 PHE A 159 2.333 4.848 -1.038 1.00 0.00 H new ATOM 0 HE2 PHE A 159 5.933 4.671 1.316 1.00 0.00 H new ATOM 0 HZ PHE A 159 4.075 5.991 0.319 1.00 0.00 H new ATOM 440 N LYS A 160 7.061 -0.296 -1.251 1.00 0.00 N ATOM 441 CA LYS A 160 8.490 -0.051 -1.395 1.00 0.00 C ATOM 442 C LYS A 160 8.900 -0.043 -2.874 1.00 0.00 C ATOM 443 O LYS A 160 9.549 0.889 -3.347 1.00 0.00 O ATOM 444 CB LYS A 160 9.293 -1.052 -0.538 1.00 0.00 C ATOM 445 CG LYS A 160 10.453 -0.386 0.224 1.00 0.00 C ATOM 446 CD LYS A 160 10.977 -1.203 1.410 1.00 0.00 C ATOM 447 CE LYS A 160 11.146 -2.691 1.085 1.00 0.00 C ATOM 448 NZ LYS A 160 11.838 -3.400 2.175 1.00 0.00 N ATOM 0 H LYS A 160 6.830 -1.061 -0.617 1.00 0.00 H new ATOM 0 HA LYS A 160 8.727 0.943 -1.016 1.00 0.00 H new ATOM 0 HB2 LYS A 160 8.623 -1.532 0.176 1.00 0.00 H new ATOM 0 HB3 LYS A 160 9.690 -1.838 -1.181 1.00 0.00 H new ATOM 0 HG2 LYS A 160 11.274 -0.207 -0.471 1.00 0.00 H new ATOM 0 HG3 LYS A 160 10.124 0.588 0.586 1.00 0.00 H new ATOM 0 HD2 LYS A 160 11.936 -0.795 1.729 1.00 0.00 H new ATOM 0 HD3 LYS A 160 10.290 -1.096 2.249 1.00 0.00 H new ATOM 0 HE2 LYS A 160 10.168 -3.142 0.917 1.00 0.00 H new ATOM 0 HE3 LYS A 160 11.711 -2.802 0.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 11.938 -4.405 1.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 12.780 -2.983 2.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 11.285 -3.313 3.052 1.00 0.00 H new ATOM 462 N ARG A 161 8.521 -1.074 -3.628 1.00 0.00 N ATOM 463 CA ARG A 161 8.834 -1.150 -5.048 1.00 0.00 C ATOM 464 C ARG A 161 8.066 -0.084 -5.834 1.00 0.00 C ATOM 465 O ARG A 161 8.663 0.662 -6.610 1.00 0.00 O ATOM 466 CB ARG A 161 8.487 -2.556 -5.546 1.00 0.00 C ATOM 467 CG ARG A 161 9.398 -3.627 -4.928 1.00 0.00 C ATOM 468 CD ARG A 161 8.881 -5.032 -5.246 1.00 0.00 C ATOM 469 NE ARG A 161 7.627 -5.306 -4.530 1.00 0.00 N ATOM 470 CZ ARG A 161 6.936 -6.451 -4.625 1.00 0.00 C ATOM 471 NH1 ARG A 161 7.369 -7.432 -5.423 1.00 0.00 N ATOM 472 NH2 ARG A 161 5.813 -6.618 -3.918 1.00 0.00 N ATOM 0 H ARG A 161 7.993 -1.871 -3.273 1.00 0.00 H new ATOM 0 HA ARG A 161 9.896 -0.959 -5.202 1.00 0.00 H new ATOM 0 HB2 ARG A 161 7.448 -2.780 -5.304 1.00 0.00 H new ATOM 0 HB3 ARG A 161 8.575 -2.588 -6.632 1.00 0.00 H new ATOM 0 HG2 ARG A 161 10.412 -3.513 -5.311 1.00 0.00 H new ATOM 0 HG3 ARG A 161 9.448 -3.489 -3.848 1.00 0.00 H new ATOM 0 HD2 ARG A 161 8.720 -5.130 -6.320 1.00 0.00 H new ATOM 0 HD3 ARG A 161 9.632 -5.771 -4.968 1.00 0.00 H new ATOM 0 HE ARG A 161 7.258 -4.576 -3.920 1.00 0.00 H new ATOM 0 HH11 ARG A 161 8.227 -7.310 -5.961 1.00 0.00 H new ATOM 0 HH12 ARG A 161 6.842 -8.302 -5.494 1.00 0.00 H new ATOM 0 HH21 ARG A 161 5.481 -5.873 -3.305 1.00 0.00 H new ATOM 0 HH22 ARG A 161 5.289 -7.490 -3.992 1.00 0.00 H new ATOM 486 N THR A 162 6.746 -0.016 -5.642 1.00 0.00 N ATOM 487 CA THR A 162 5.868 0.921 -6.331 1.00 0.00 C ATOM 488 C THR A 162 6.360 2.357 -6.194 1.00 0.00 C ATOM 489 O THR A 162 6.311 3.098 -7.164 1.00 0.00 O ATOM 490 CB THR A 162 4.422 0.780 -5.833 1.00 0.00 C ATOM 491 OG1 THR A 162 3.944 -0.518 -6.133 1.00 0.00 O ATOM 492 CG2 THR A 162 3.484 1.797 -6.489 1.00 0.00 C ATOM 0 H THR A 162 6.252 -0.625 -4.989 1.00 0.00 H new ATOM 0 HA THR A 162 5.887 0.673 -7.392 1.00 0.00 H new ATOM 0 HB THR A 162 4.432 0.960 -4.758 1.00 0.00 H new ATOM 0 HG1 THR A 162 4.250 -1.146 -5.446 1.00 0.00 H new ATOM 0 HG21 THR A 162 2.473 1.659 -6.106 1.00 0.00 H new ATOM 0 HG22 THR A 162 3.824 2.807 -6.260 1.00 0.00 H new ATOM 0 HG23 THR A 162 3.486 1.650 -7.569 1.00 0.00 H new ATOM 500 N VAL A 163 6.821 2.781 -5.021 1.00 0.00 N ATOM 501 CA VAL A 163 7.301 4.142 -4.834 1.00 0.00 C ATOM 502 C VAL A 163 8.467 4.432 -5.777 1.00 0.00 C ATOM 503 O VAL A 163 8.473 5.449 -6.472 1.00 0.00 O ATOM 504 CB VAL A 163 7.672 4.344 -3.360 1.00 0.00 C ATOM 505 CG1 VAL A 163 8.691 5.472 -3.123 1.00 0.00 C ATOM 506 CG2 VAL A 163 6.377 4.617 -2.582 1.00 0.00 C ATOM 0 H VAL A 163 6.871 2.198 -4.185 1.00 0.00 H new ATOM 0 HA VAL A 163 6.516 4.855 -5.084 1.00 0.00 H new ATOM 0 HB VAL A 163 8.165 3.437 -3.010 1.00 0.00 H new ATOM 0 HG11 VAL A 163 8.902 5.553 -2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 163 9.613 5.248 -3.660 1.00 0.00 H new ATOM 0 HG13 VAL A 163 8.281 6.415 -3.484 1.00 0.00 H new ATOM 0 HG21 VAL A 163 6.610 4.765 -1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 163 5.897 5.513 -2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 163 5.703 3.767 -2.689 1.00 0.00 H new ATOM 516 N ARG A 164 9.458 3.540 -5.782 1.00 0.00 N ATOM 517 CA ARG A 164 10.644 3.699 -6.615 1.00 0.00 C ATOM 518 C ARG A 164 10.333 3.596 -8.110 1.00 0.00 C ATOM 519 O ARG A 164 10.821 4.393 -8.906 1.00 0.00 O ATOM 520 CB ARG A 164 11.720 2.689 -6.193 1.00 0.00 C ATOM 521 CG ARG A 164 12.267 3.073 -4.812 1.00 0.00 C ATOM 522 CD ARG A 164 13.664 2.498 -4.561 1.00 0.00 C ATOM 523 NE ARG A 164 14.048 2.740 -3.166 1.00 0.00 N ATOM 524 CZ ARG A 164 15.085 2.184 -2.529 1.00 0.00 C ATOM 525 NH1 ARG A 164 16.001 1.484 -3.204 1.00 0.00 N ATOM 526 NH2 ARG A 164 15.190 2.326 -1.207 1.00 0.00 N ATOM 0 H ARG A 164 9.459 2.694 -5.212 1.00 0.00 H new ATOM 0 HA ARG A 164 11.026 4.708 -6.457 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.299 1.684 -6.163 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.528 2.674 -6.925 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.303 4.159 -4.727 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.585 2.715 -4.041 1.00 0.00 H new ATOM 0 HD2 ARG A 164 13.672 1.429 -4.772 1.00 0.00 H new ATOM 0 HD3 ARG A 164 14.386 2.961 -5.234 1.00 0.00 H new ATOM 0 HE ARG A 164 13.472 3.392 -2.633 1.00 0.00 H new ATOM 0 HH11 ARG A 164 15.913 1.370 -4.214 1.00 0.00 H new ATOM 0 HH12 ARG A 164 16.788 1.064 -2.710 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.484 2.854 -0.693 1.00 0.00 H new ATOM 0 HH22 ARG A 164 15.976 1.907 -0.710 1.00 0.00 H new ATOM 540 N LYS A 165 9.557 2.587 -8.497 1.00 0.00 N ATOM 541 CA LYS A 165 9.233 2.306 -9.891 1.00 0.00 C ATOM 542 C LYS A 165 8.150 3.239 -10.458 1.00 0.00 C ATOM 543 O LYS A 165 8.152 3.550 -11.645 1.00 0.00 O ATOM 544 CB LYS A 165 8.767 0.854 -9.978 1.00 0.00 C ATOM 545 CG LYS A 165 9.865 -0.175 -9.685 1.00 0.00 C ATOM 546 CD LYS A 165 10.486 -0.642 -11.007 1.00 0.00 C ATOM 547 CE LYS A 165 11.653 -1.611 -10.786 1.00 0.00 C ATOM 548 NZ LYS A 165 11.227 -2.844 -10.101 1.00 0.00 N ATOM 0 H LYS A 165 9.130 1.933 -7.841 1.00 0.00 H new ATOM 0 HA LYS A 165 10.126 2.478 -10.492 1.00 0.00 H new ATOM 0 HB2 LYS A 165 7.947 0.704 -9.276 1.00 0.00 H new ATOM 0 HB3 LYS A 165 8.369 0.671 -10.976 1.00 0.00 H new ATOM 0 HG2 LYS A 165 10.630 0.265 -9.045 1.00 0.00 H new ATOM 0 HG3 LYS A 165 9.448 -1.025 -9.145 1.00 0.00 H new ATOM 0 HD2 LYS A 165 9.722 -1.128 -11.614 1.00 0.00 H new ATOM 0 HD3 LYS A 165 10.836 0.224 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS A 165 12.099 -1.866 -11.747 1.00 0.00 H new ATOM 0 HE3 LYS A 165 12.426 -1.118 -10.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 12.023 -3.512 -10.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 10.920 -2.615 -9.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 10.437 -3.276 -10.622 1.00 0.00 H new ATOM 562 N ASP A 166 7.206 3.639 -9.608 1.00 0.00 N ATOM 563 CA ASP A 166 6.044 4.472 -9.897 1.00 0.00 C ATOM 564 C ASP A 166 5.183 3.909 -11.029 1.00 0.00 C ATOM 565 O ASP A 166 4.903 4.585 -12.015 1.00 0.00 O ATOM 566 CB ASP A 166 6.436 5.942 -10.081 1.00 0.00 C ATOM 567 CG ASP A 166 5.211 6.857 -10.023 1.00 0.00 C ATOM 568 OD1 ASP A 166 4.456 6.738 -9.030 1.00 0.00 O ATOM 569 OD2 ASP A 166 5.060 7.672 -10.957 1.00 0.00 O ATOM 0 H ASP A 166 7.238 3.368 -8.625 1.00 0.00 H new ATOM 0 HA ASP A 166 5.396 4.445 -9.021 1.00 0.00 H new ATOM 0 HB2 ASP A 166 7.145 6.231 -9.305 1.00 0.00 H new ATOM 0 HB3 ASP A 166 6.942 6.068 -11.038 1.00 0.00 H new ATOM 574 N LEU A 167 4.734 2.661 -10.864 1.00 0.00 N ATOM 575 CA LEU A 167 3.867 1.992 -11.819 1.00 0.00 C ATOM 576 C LEU A 167 2.567 2.775 -12.002 1.00 0.00 C ATOM 577 O LEU A 167 1.832 3.011 -11.042 1.00 0.00 O ATOM 578 CB LEU A 167 3.519 0.594 -11.301 1.00 0.00 C ATOM 579 CG LEU A 167 4.557 -0.498 -11.583 1.00 0.00 C ATOM 580 CD1 LEU A 167 4.468 -0.984 -13.035 1.00 0.00 C ATOM 581 CD2 LEU A 167 5.985 -0.078 -11.251 1.00 0.00 C ATOM 0 H LEU A 167 4.969 2.088 -10.054 1.00 0.00 H new ATOM 0 HA LEU A 167 4.391 1.927 -12.773 1.00 0.00 H new ATOM 0 HB2 LEU A 167 3.366 0.654 -10.224 1.00 0.00 H new ATOM 0 HB3 LEU A 167 2.570 0.289 -11.742 1.00 0.00 H new ATOM 0 HG LEU A 167 4.310 -1.322 -10.914 1.00 0.00 H new ATOM 0 HD11 LEU A 167 5.216 -1.758 -13.206 1.00 0.00 H new ATOM 0 HD12 LEU A 167 3.475 -1.392 -13.222 1.00 0.00 H new ATOM 0 HD13 LEU A 167 4.650 -0.148 -13.710 1.00 0.00 H new ATOM 0 HD21 LEU A 167 6.667 -0.898 -11.475 1.00 0.00 H new ATOM 0 HD22 LEU A 167 6.256 0.793 -11.848 1.00 0.00 H new ATOM 0 HD23 LEU A 167 6.054 0.172 -10.192 1.00 0.00 H new ATOM 593 N THR A 168 2.257 3.134 -13.245 1.00 0.00 N ATOM 594 CA THR A 168 1.036 3.829 -13.594 1.00 0.00 C ATOM 595 C THR A 168 -0.109 2.817 -13.600 1.00 0.00 C ATOM 596 O THR A 168 -0.579 2.418 -14.666 1.00 0.00 O ATOM 597 CB THR A 168 1.237 4.480 -14.966 1.00 0.00 C ATOM 598 OG1 THR A 168 1.688 3.492 -15.871 1.00 0.00 O ATOM 599 CG2 THR A 168 2.280 5.598 -14.887 1.00 0.00 C ATOM 0 H THR A 168 2.861 2.944 -14.045 1.00 0.00 H new ATOM 0 HA THR A 168 0.790 4.611 -12.876 1.00 0.00 H new ATOM 0 HB THR A 168 0.292 4.908 -15.300 1.00 0.00 H new ATOM 0 HG1 THR A 168 1.076 2.727 -15.851 1.00 0.00 H new ATOM 0 HG21 THR A 168 2.407 6.047 -15.872 1.00 0.00 H new ATOM 0 HG22 THR A 168 1.945 6.359 -14.182 1.00 0.00 H new ATOM 0 HG23 THR A 168 3.231 5.185 -14.551 1.00 0.00 H new ATOM 607 N TYR A 169 -0.535 2.380 -12.414 1.00 0.00 N ATOM 608 CA TYR A 169 -1.618 1.415 -12.284 1.00 0.00 C ATOM 609 C TYR A 169 -2.955 2.127 -12.531 1.00 0.00 C ATOM 610 O TYR A 169 -3.031 3.356 -12.527 1.00 0.00 O ATOM 611 CB TYR A 169 -1.639 0.830 -10.866 1.00 0.00 C ATOM 612 CG TYR A 169 -0.358 0.245 -10.302 1.00 0.00 C ATOM 613 CD1 TYR A 169 0.198 -0.921 -10.863 1.00 0.00 C ATOM 614 CD2 TYR A 169 0.111 0.705 -9.057 1.00 0.00 C ATOM 615 CE1 TYR A 169 1.246 -1.593 -10.204 1.00 0.00 C ATOM 616 CE2 TYR A 169 1.129 0.011 -8.386 1.00 0.00 C ATOM 617 CZ TYR A 169 1.730 -1.110 -8.976 1.00 0.00 C ATOM 618 OH TYR A 169 2.779 -1.727 -8.359 1.00 0.00 O ATOM 0 H TYR A 169 -0.140 2.685 -11.525 1.00 0.00 H new ATOM 0 HA TYR A 169 -1.466 0.615 -13.008 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -1.970 1.617 -10.188 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -2.398 0.048 -10.842 1.00 0.00 H new ATOM 0 HD1 TYR A 169 -0.180 -1.301 -11.801 1.00 0.00 H new ATOM 0 HD2 TYR A 169 -0.314 1.595 -8.617 1.00 0.00 H new ATOM 0 HE1 TYR A 169 1.678 -2.480 -10.643 1.00 0.00 H new ATOM 0 HE2 TYR A 169 1.451 0.342 -7.410 1.00 0.00 H new ATOM 0 HH TYR A 169 3.078 -1.184 -7.600 1.00 0.00 H new ATOM 628 N THR A 170 -4.035 1.363 -12.715 1.00 0.00 N ATOM 629 CA THR A 170 -5.385 1.882 -12.898 1.00 0.00 C ATOM 630 C THR A 170 -6.360 0.789 -12.444 1.00 0.00 C ATOM 631 O THR A 170 -5.977 -0.380 -12.389 1.00 0.00 O ATOM 632 CB THR A 170 -5.596 2.286 -14.371 1.00 0.00 C ATOM 633 OG1 THR A 170 -4.576 3.165 -14.797 1.00 0.00 O ATOM 634 CG2 THR A 170 -6.933 2.995 -14.611 1.00 0.00 C ATOM 0 H THR A 170 -3.990 0.344 -12.741 1.00 0.00 H new ATOM 0 HA THR A 170 -5.556 2.780 -12.304 1.00 0.00 H new ATOM 0 HB THR A 170 -5.581 1.353 -14.934 1.00 0.00 H new ATOM 0 HG1 THR A 170 -4.725 3.409 -15.734 1.00 0.00 H new ATOM 0 HG21 THR A 170 -7.023 3.254 -15.666 1.00 0.00 H new ATOM 0 HG22 THR A 170 -7.752 2.333 -14.329 1.00 0.00 H new ATOM 0 HG23 THR A 170 -6.977 3.903 -14.009 1.00 0.00 H new ATOM 642 N CYS A 171 -7.602 1.159 -12.120 1.00 0.00 N ATOM 643 CA CYS A 171 -8.677 0.261 -11.721 1.00 0.00 C ATOM 644 C CYS A 171 -9.967 0.895 -12.228 1.00 0.00 C ATOM 645 O CYS A 171 -10.089 2.119 -12.186 1.00 0.00 O ATOM 646 CB CYS A 171 -8.718 0.122 -10.195 1.00 0.00 C ATOM 647 SG CYS A 171 -10.040 -0.927 -9.536 1.00 0.00 S ATOM 0 H CYS A 171 -7.893 2.136 -12.131 1.00 0.00 H new ATOM 0 HA CYS A 171 -8.534 -0.738 -12.133 1.00 0.00 H new ATOM 0 HB2 CYS A 171 -7.761 -0.278 -9.859 1.00 0.00 H new ATOM 0 HB3 CYS A 171 -8.818 1.117 -9.761 1.00 0.00 H new ATOM 0 HG CYS A 171 -9.600 -1.582 -8.503 1.00 0.00 H new ATOM 652 N ARG A 172 -10.929 0.096 -12.692 1.00 0.00 N ATOM 653 CA ARG A 172 -12.202 0.595 -13.205 1.00 0.00 C ATOM 654 C ARG A 172 -13.145 0.949 -12.048 1.00 0.00 C ATOM 655 O ARG A 172 -14.280 0.483 -12.003 1.00 0.00 O ATOM 656 CB ARG A 172 -12.821 -0.446 -14.149 1.00 0.00 C ATOM 657 CG ARG A 172 -11.903 -0.757 -15.339 1.00 0.00 C ATOM 658 CD ARG A 172 -12.575 -1.756 -16.285 1.00 0.00 C ATOM 659 NE ARG A 172 -11.692 -2.084 -17.412 1.00 0.00 N ATOM 660 CZ ARG A 172 -11.998 -2.945 -18.393 1.00 0.00 C ATOM 661 NH1 ARG A 172 -13.180 -3.570 -18.398 1.00 0.00 N ATOM 662 NH2 ARG A 172 -11.113 -3.174 -19.369 1.00 0.00 N ATOM 0 H ARG A 172 -10.845 -0.920 -12.722 1.00 0.00 H new ATOM 0 HA ARG A 172 -12.033 1.509 -13.774 1.00 0.00 H new ATOM 0 HB2 ARG A 172 -13.022 -1.364 -13.596 1.00 0.00 H new ATOM 0 HB3 ARG A 172 -13.779 -0.079 -14.516 1.00 0.00 H new ATOM 0 HG2 ARG A 172 -11.670 0.162 -15.876 1.00 0.00 H new ATOM 0 HG3 ARG A 172 -10.958 -1.165 -14.981 1.00 0.00 H new ATOM 0 HD2 ARG A 172 -12.829 -2.665 -15.740 1.00 0.00 H new ATOM 0 HD3 ARG A 172 -13.509 -1.337 -16.659 1.00 0.00 H new ATOM 0 HE ARG A 172 -10.782 -1.624 -17.451 1.00 0.00 H new ATOM 0 HH11 ARG A 172 -13.854 -3.393 -17.653 1.00 0.00 H new ATOM 0 HH12 ARG A 172 -13.408 -4.224 -19.147 1.00 0.00 H new ATOM 0 HH21 ARG A 172 -10.212 -2.695 -19.364 1.00 0.00 H new ATOM 0 HH22 ARG A 172 -11.338 -3.828 -20.119 1.00 0.00 H new ATOM 676 N ASP A 173 -12.671 1.786 -11.122 1.00 0.00 N ATOM 677 CA ASP A 173 -13.399 2.261 -9.951 1.00 0.00 C ATOM 678 C ASP A 173 -12.800 3.626 -9.586 1.00 0.00 C ATOM 679 O ASP A 173 -12.535 4.437 -10.469 1.00 0.00 O ATOM 680 CB ASP A 173 -13.313 1.243 -8.795 1.00 0.00 C ATOM 681 CG ASP A 173 -13.975 -0.097 -9.102 1.00 0.00 C ATOM 682 OD1 ASP A 173 -15.209 -0.172 -8.920 1.00 0.00 O ATOM 683 OD2 ASP A 173 -13.231 -1.028 -9.481 1.00 0.00 O ATOM 0 H ASP A 173 -11.726 2.166 -11.174 1.00 0.00 H new ATOM 0 HA ASP A 173 -14.464 2.369 -10.158 1.00 0.00 H new ATOM 0 HB2 ASP A 173 -12.264 1.072 -8.552 1.00 0.00 H new ATOM 0 HB3 ASP A 173 -13.780 1.673 -7.909 1.00 0.00 H new ATOM 688 N ASN A 174 -12.531 3.874 -8.304 1.00 0.00 N ATOM 689 CA ASN A 174 -11.891 5.055 -7.738 1.00 0.00 C ATOM 690 C ASN A 174 -11.029 4.521 -6.595 1.00 0.00 C ATOM 691 O ASN A 174 -11.174 3.357 -6.229 1.00 0.00 O ATOM 692 CB ASN A 174 -12.932 6.054 -7.195 1.00 0.00 C ATOM 693 CG ASN A 174 -13.380 7.149 -8.166 1.00 0.00 C ATOM 694 OD1 ASN A 174 -13.747 8.233 -7.727 1.00 0.00 O ATOM 695 ND2 ASN A 174 -13.347 6.925 -9.476 1.00 0.00 N ATOM 0 H ASN A 174 -12.776 3.199 -7.580 1.00 0.00 H new ATOM 0 HA ASN A 174 -11.312 5.594 -8.488 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -13.812 5.495 -6.878 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -12.520 6.531 -6.306 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -13.629 7.659 -10.126 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -13.040 6.019 -9.831 1.00 0.00 H new ATOM 702 N LYS A 175 -10.144 5.346 -6.032 1.00 0.00 N ATOM 703 CA LYS A 175 -9.253 4.946 -4.946 1.00 0.00 C ATOM 704 C LYS A 175 -9.972 4.205 -3.808 1.00 0.00 C ATOM 705 O LYS A 175 -9.465 3.208 -3.296 1.00 0.00 O ATOM 706 CB LYS A 175 -8.449 6.158 -4.453 1.00 0.00 C ATOM 707 CG LYS A 175 -9.298 7.349 -3.981 1.00 0.00 C ATOM 708 CD LYS A 175 -8.426 8.508 -3.469 1.00 0.00 C ATOM 709 CE LYS A 175 -7.458 9.092 -4.509 1.00 0.00 C ATOM 710 NZ LYS A 175 -8.143 9.496 -5.750 1.00 0.00 N ATOM 0 H LYS A 175 -10.026 6.317 -6.320 1.00 0.00 H new ATOM 0 HA LYS A 175 -8.553 4.213 -5.347 1.00 0.00 H new ATOM 0 HB2 LYS A 175 -7.807 5.840 -3.632 1.00 0.00 H new ATOM 0 HB3 LYS A 175 -7.795 6.493 -5.258 1.00 0.00 H new ATOM 0 HG2 LYS A 175 -9.921 7.699 -4.804 1.00 0.00 H new ATOM 0 HG3 LYS A 175 -9.971 7.023 -3.188 1.00 0.00 H new ATOM 0 HD2 LYS A 175 -9.078 9.305 -3.112 1.00 0.00 H new ATOM 0 HD3 LYS A 175 -7.850 8.160 -2.612 1.00 0.00 H new ATOM 0 HE2 LYS A 175 -6.947 9.955 -4.082 1.00 0.00 H new ATOM 0 HE3 LYS A 175 -6.692 8.353 -4.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 -7.457 9.930 -6.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 -8.566 8.660 -6.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 -8.890 10.184 -5.526 1.00 0.00 H new ATOM 724 N ASP A 176 -11.167 4.669 -3.434 1.00 0.00 N ATOM 725 CA ASP A 176 -11.986 4.062 -2.391 1.00 0.00 C ATOM 726 C ASP A 176 -12.718 2.840 -2.955 1.00 0.00 C ATOM 727 O ASP A 176 -13.945 2.796 -3.009 1.00 0.00 O ATOM 728 CB ASP A 176 -12.953 5.111 -1.820 1.00 0.00 C ATOM 729 CG ASP A 176 -13.790 4.560 -0.666 1.00 0.00 C ATOM 730 OD1 ASP A 176 -13.222 3.786 0.134 1.00 0.00 O ATOM 731 OD2 ASP A 176 -14.976 4.946 -0.592 1.00 0.00 O ATOM 0 H ASP A 176 -11.597 5.492 -3.857 1.00 0.00 H new ATOM 0 HA ASP A 176 -11.357 3.715 -1.571 1.00 0.00 H new ATOM 0 HB2 ASP A 176 -12.386 5.975 -1.474 1.00 0.00 H new ATOM 0 HB3 ASP A 176 -13.615 5.461 -2.612 1.00 0.00 H new ATOM 736 N CYS A 177 -11.941 1.857 -3.402 1.00 0.00 N ATOM 737 CA CYS A 177 -12.428 0.616 -3.992 1.00 0.00 C ATOM 738 C CYS A 177 -12.693 -0.417 -2.893 1.00 0.00 C ATOM 739 O CYS A 177 -12.304 -0.231 -1.739 1.00 0.00 O ATOM 740 CB CYS A 177 -11.380 0.156 -5.009 1.00 0.00 C ATOM 741 SG CYS A 177 -11.761 -1.210 -6.134 1.00 0.00 S ATOM 0 H CYS A 177 -10.923 1.905 -3.362 1.00 0.00 H new ATOM 0 HA CYS A 177 -13.379 0.755 -4.507 1.00 0.00 H new ATOM 0 HB2 CYS A 177 -11.120 1.019 -5.621 1.00 0.00 H new ATOM 0 HB3 CYS A 177 -10.485 -0.121 -4.452 1.00 0.00 H new ATOM 0 HG CYS A 177 -11.138 -1.031 -7.261 1.00 0.00 H new ATOM 746 N LEU A 178 -13.359 -1.520 -3.243 1.00 0.00 N ATOM 747 CA LEU A 178 -13.698 -2.589 -2.314 1.00 0.00 C ATOM 748 C LEU A 178 -12.450 -3.415 -1.966 1.00 0.00 C ATOM 749 O LEU A 178 -12.320 -4.575 -2.360 1.00 0.00 O ATOM 750 CB LEU A 178 -14.830 -3.426 -2.935 1.00 0.00 C ATOM 751 CG LEU A 178 -15.429 -4.498 -2.008 1.00 0.00 C ATOM 752 CD1 LEU A 178 -16.077 -3.892 -0.757 1.00 0.00 C ATOM 753 CD2 LEU A 178 -16.482 -5.299 -2.781 1.00 0.00 C ATOM 0 H LEU A 178 -13.681 -1.694 -4.195 1.00 0.00 H new ATOM 0 HA LEU A 178 -14.057 -2.185 -1.367 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -15.628 -2.754 -3.251 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -14.450 -3.914 -3.833 1.00 0.00 H new ATOM 0 HG LEU A 178 -14.614 -5.142 -1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -16.485 -4.690 -0.136 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -15.328 -3.338 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.880 -3.217 -1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -16.910 -6.061 -2.129 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -17.270 -4.629 -3.123 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.015 -5.778 -3.641 1.00 0.00 H new ATOM 765 N ILE A 179 -11.508 -2.820 -1.229 1.00 0.00 N ATOM 766 CA ILE A 179 -10.274 -3.486 -0.824 1.00 0.00 C ATOM 767 C ILE A 179 -10.560 -4.437 0.344 1.00 0.00 C ATOM 768 O ILE A 179 -10.091 -4.240 1.463 1.00 0.00 O ATOM 769 CB ILE A 179 -9.148 -2.464 -0.541 1.00 0.00 C ATOM 770 CG1 ILE A 179 -8.971 -1.442 -1.681 1.00 0.00 C ATOM 771 CG2 ILE A 179 -7.802 -3.176 -0.312 1.00 0.00 C ATOM 772 CD1 ILE A 179 -8.551 -2.081 -3.005 1.00 0.00 C ATOM 0 H ILE A 179 -11.583 -1.859 -0.897 1.00 0.00 H new ATOM 0 HA ILE A 179 -9.900 -4.097 -1.645 1.00 0.00 H new ATOM 0 HB ILE A 179 -9.451 -1.929 0.359 1.00 0.00 H new ATOM 0 HG12 ILE A 179 -9.908 -0.904 -1.826 1.00 0.00 H new ATOM 0 HG13 ILE A 179 -8.223 -0.706 -1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 179 -7.027 -2.435 -0.115 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -7.887 -3.848 0.542 1.00 0.00 H new ATOM 0 HG23 ILE A 179 -7.538 -3.750 -1.200 1.00 0.00 H new ATOM 0 HD11 ILE A 179 -8.444 -1.307 -3.765 1.00 0.00 H new ATOM 0 HD12 ILE A 179 -7.599 -2.596 -2.875 1.00 0.00 H new ATOM 0 HD13 ILE A 179 -9.310 -2.797 -3.321 1.00 0.00 H new ATOM 784 N ASP A 180 -11.327 -5.494 0.067 1.00 0.00 N ATOM 785 CA ASP A 180 -11.599 -6.536 1.048 1.00 0.00 C ATOM 786 C ASP A 180 -10.306 -7.323 1.259 1.00 0.00 C ATOM 787 O ASP A 180 -9.413 -7.274 0.413 1.00 0.00 O ATOM 788 CB ASP A 180 -12.711 -7.476 0.557 1.00 0.00 C ATOM 789 CG ASP A 180 -14.091 -6.826 0.499 1.00 0.00 C ATOM 790 OD1 ASP A 180 -14.281 -5.796 1.182 1.00 0.00 O ATOM 791 OD2 ASP A 180 -14.941 -7.391 -0.221 1.00 0.00 O ATOM 0 H ASP A 180 -11.772 -5.647 -0.838 1.00 0.00 H new ATOM 0 HA ASP A 180 -11.937 -6.087 1.982 1.00 0.00 H new ATOM 0 HB2 ASP A 180 -12.451 -7.842 -0.436 1.00 0.00 H new ATOM 0 HB3 ASP A 180 -12.756 -8.344 1.215 1.00 0.00 H new ATOM 921 N CYS A 187 -5.647 -5.491 -6.032 1.00 0.00 N ATOM 922 CA CYS A 187 -6.047 -4.195 -6.563 1.00 0.00 C ATOM 923 C CYS A 187 -4.965 -3.111 -6.409 1.00 0.00 C ATOM 924 O CYS A 187 -5.139 -2.127 -5.688 1.00 0.00 O ATOM 925 CB CYS A 187 -7.377 -3.838 -5.901 1.00 0.00 C ATOM 926 SG CYS A 187 -8.275 -2.500 -6.697 1.00 0.00 S ATOM 0 HA CYS A 187 -6.176 -4.253 -7.644 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -8.010 -4.725 -5.887 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -7.189 -3.564 -4.863 1.00 0.00 H new ATOM 0 HG CYS A 187 -9.465 -2.409 -6.181 1.00 0.00 H new ATOM 931 N GLN A 188 -3.844 -3.308 -7.110 1.00 0.00 N ATOM 932 CA GLN A 188 -2.650 -2.463 -7.092 1.00 0.00 C ATOM 933 C GLN A 188 -2.939 -0.955 -7.006 1.00 0.00 C ATOM 934 O GLN A 188 -2.564 -0.313 -6.026 1.00 0.00 O ATOM 935 CB GLN A 188 -1.766 -2.759 -8.316 1.00 0.00 C ATOM 936 CG GLN A 188 -1.463 -4.245 -8.565 1.00 0.00 C ATOM 937 CD GLN A 188 -0.937 -4.970 -7.329 1.00 0.00 C ATOM 938 OE1 GLN A 188 0.041 -4.550 -6.723 1.00 0.00 O ATOM 939 NE2 GLN A 188 -1.594 -6.049 -6.921 1.00 0.00 N ATOM 0 H GLN A 188 -3.742 -4.105 -7.739 1.00 0.00 H new ATOM 0 HA GLN A 188 -2.125 -2.721 -6.172 1.00 0.00 H new ATOM 0 HB2 GLN A 188 -2.253 -2.351 -9.202 1.00 0.00 H new ATOM 0 HB3 GLN A 188 -0.822 -2.228 -8.198 1.00 0.00 H new ATOM 0 HG2 GLN A 188 -2.371 -4.741 -8.910 1.00 0.00 H new ATOM 0 HG3 GLN A 188 -0.729 -4.330 -9.367 1.00 0.00 H new ATOM 0 HE21 GLN A 188 -2.406 -6.379 -7.443 1.00 0.00 H new ATOM 0 HE22 GLN A 188 -1.287 -6.548 -6.086 1.00 0.00 H new ATOM 948 N TYR A 189 -3.572 -0.371 -8.030 1.00 0.00 N ATOM 949 CA TYR A 189 -3.838 1.066 -8.081 1.00 0.00 C ATOM 950 C TYR A 189 -4.440 1.582 -6.783 1.00 0.00 C ATOM 951 O TYR A 189 -3.870 2.440 -6.115 1.00 0.00 O ATOM 952 CB TYR A 189 -4.776 1.391 -9.249 1.00 0.00 C ATOM 953 CG TYR A 189 -5.237 2.839 -9.303 1.00 0.00 C ATOM 954 CD1 TYR A 189 -4.304 3.886 -9.424 1.00 0.00 C ATOM 955 CD2 TYR A 189 -6.600 3.144 -9.142 1.00 0.00 C ATOM 956 CE1 TYR A 189 -4.740 5.225 -9.404 1.00 0.00 C ATOM 957 CE2 TYR A 189 -7.039 4.478 -9.158 1.00 0.00 C ATOM 958 CZ TYR A 189 -6.108 5.521 -9.281 1.00 0.00 C ATOM 959 OH TYR A 189 -6.528 6.803 -9.094 1.00 0.00 O ATOM 0 H TYR A 189 -3.913 -0.883 -8.844 1.00 0.00 H new ATOM 0 HA TYR A 189 -2.881 1.566 -8.227 1.00 0.00 H new ATOM 0 HB2 TYR A 189 -4.270 1.149 -10.183 1.00 0.00 H new ATOM 0 HB3 TYR A 189 -5.652 0.746 -9.185 1.00 0.00 H new ATOM 0 HD1 TYR A 189 -3.253 3.662 -9.532 1.00 0.00 H new ATOM 0 HD2 TYR A 189 -7.315 2.346 -9.005 1.00 0.00 H new ATOM 0 HE1 TYR A 189 -4.021 6.027 -9.483 1.00 0.00 H new ATOM 0 HE2 TYR A 189 -8.092 4.701 -9.076 1.00 0.00 H new ATOM 0 HH TYR A 189 -6.116 7.167 -8.283 1.00 0.00 H new ATOM 969 N CYS A 190 -5.609 1.054 -6.440 1.00 0.00 N ATOM 970 CA CYS A 190 -6.323 1.458 -5.252 1.00 0.00 C ATOM 971 C CYS A 190 -5.448 1.258 -4.018 1.00 0.00 C ATOM 972 O CYS A 190 -5.410 2.148 -3.178 1.00 0.00 O ATOM 973 CB CYS A 190 -7.639 0.702 -5.208 1.00 0.00 C ATOM 974 SG CYS A 190 -8.718 1.088 -6.619 1.00 0.00 S ATOM 0 H CYS A 190 -6.083 0.333 -6.984 1.00 0.00 H new ATOM 0 HA CYS A 190 -6.559 2.522 -5.269 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -7.438 -0.369 -5.192 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -8.160 0.942 -4.281 1.00 0.00 H new ATOM 0 HG CYS A 190 -8.968 -0.000 -7.285 1.00 0.00 H new ATOM 979 N ARG A 191 -4.703 0.152 -3.903 1.00 0.00 N ATOM 980 CA ARG A 191 -3.792 -0.006 -2.771 1.00 0.00 C ATOM 981 C ARG A 191 -2.777 1.145 -2.713 1.00 0.00 C ATOM 982 O ARG A 191 -2.555 1.710 -1.644 1.00 0.00 O ATOM 983 CB ARG A 191 -3.057 -1.347 -2.804 1.00 0.00 C ATOM 984 CG ARG A 191 -3.976 -2.540 -2.520 1.00 0.00 C ATOM 985 CD ARG A 191 -3.128 -3.774 -2.196 1.00 0.00 C ATOM 986 NE ARG A 191 -2.090 -3.999 -3.214 1.00 0.00 N ATOM 987 CZ ARG A 191 -0.933 -4.639 -3.000 1.00 0.00 C ATOM 988 NH1 ARG A 191 -0.636 -5.162 -1.805 1.00 0.00 N ATOM 989 NH2 ARG A 191 -0.084 -4.844 -4.007 1.00 0.00 N ATOM 0 H ARG A 191 -4.713 -0.626 -4.562 1.00 0.00 H new ATOM 0 HA ARG A 191 -4.407 0.017 -1.871 1.00 0.00 H new ATOM 0 HB2 ARG A 191 -2.593 -1.477 -3.782 1.00 0.00 H new ATOM 0 HB3 ARG A 191 -2.252 -1.332 -2.069 1.00 0.00 H new ATOM 0 HG2 ARG A 191 -4.638 -2.312 -1.685 1.00 0.00 H new ATOM 0 HG3 ARG A 191 -4.610 -2.738 -3.384 1.00 0.00 H new ATOM 0 HD2 ARG A 191 -2.660 -3.649 -1.220 1.00 0.00 H new ATOM 0 HD3 ARG A 191 -3.771 -4.652 -2.131 1.00 0.00 H new ATOM 0 HE ARG A 191 -2.264 -3.641 -4.153 1.00 0.00 H new ATOM 0 HH11 ARG A 191 -1.297 -5.078 -1.033 1.00 0.00 H new ATOM 0 HH12 ARG A 191 0.252 -5.645 -1.666 1.00 0.00 H new ATOM 0 HH21 ARG A 191 -0.315 -4.513 -4.944 1.00 0.00 H new ATOM 0 HH22 ARG A 191 0.796 -5.332 -3.841 1.00 0.00 H new ATOM 1003 N TYR A 192 -2.158 1.505 -3.844 1.00 0.00 N ATOM 1004 CA TYR A 192 -1.188 2.601 -3.887 1.00 0.00 C ATOM 1005 C TYR A 192 -1.865 3.904 -3.453 1.00 0.00 C ATOM 1006 O TYR A 192 -1.376 4.610 -2.572 1.00 0.00 O ATOM 1007 CB TYR A 192 -0.573 2.717 -5.293 1.00 0.00 C ATOM 1008 CG TYR A 192 0.478 3.797 -5.510 1.00 0.00 C ATOM 1009 CD1 TYR A 192 1.508 4.012 -4.569 1.00 0.00 C ATOM 1010 CD2 TYR A 192 0.550 4.432 -6.766 1.00 0.00 C ATOM 1011 CE1 TYR A 192 2.576 4.876 -4.875 1.00 0.00 C ATOM 1012 CE2 TYR A 192 1.639 5.260 -7.084 1.00 0.00 C ATOM 1013 CZ TYR A 192 2.657 5.478 -6.142 1.00 0.00 C ATOM 1014 OH TYR A 192 3.731 6.259 -6.458 1.00 0.00 O ATOM 0 H TYR A 192 -2.314 1.050 -4.744 1.00 0.00 H new ATOM 0 HA TYR A 192 -0.373 2.395 -3.193 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -0.126 1.756 -5.545 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -1.383 2.888 -6.002 1.00 0.00 H new ATOM 0 HD1 TYR A 192 1.476 3.512 -3.612 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -0.238 4.281 -7.489 1.00 0.00 H new ATOM 0 HE1 TYR A 192 3.335 5.077 -4.134 1.00 0.00 H new ATOM 0 HE2 TYR A 192 1.693 5.730 -8.055 1.00 0.00 H new ATOM 0 HH TYR A 192 3.902 6.206 -7.422 1.00 0.00 H new ATOM 1024 N GLN A 193 -3.012 4.218 -4.059 1.00 0.00 N ATOM 1025 CA GLN A 193 -3.776 5.405 -3.719 1.00 0.00 C ATOM 1026 C GLN A 193 -4.132 5.431 -2.230 1.00 0.00 C ATOM 1027 O GLN A 193 -3.984 6.463 -1.586 1.00 0.00 O ATOM 1028 CB GLN A 193 -5.038 5.457 -4.582 1.00 0.00 C ATOM 1029 CG GLN A 193 -4.786 5.571 -6.091 1.00 0.00 C ATOM 1030 CD GLN A 193 -4.244 6.926 -6.527 1.00 0.00 C ATOM 1031 OE1 GLN A 193 -4.978 7.747 -7.068 1.00 0.00 O ATOM 1032 NE2 GLN A 193 -2.948 7.161 -6.345 1.00 0.00 N ATOM 0 H GLN A 193 -3.431 3.653 -4.797 1.00 0.00 H new ATOM 0 HA GLN A 193 -3.166 6.286 -3.919 1.00 0.00 H new ATOM 0 HB2 GLN A 193 -5.626 4.559 -4.394 1.00 0.00 H new ATOM 0 HB3 GLN A 193 -5.643 6.306 -4.264 1.00 0.00 H new ATOM 0 HG2 GLN A 193 -4.081 4.795 -6.391 1.00 0.00 H new ATOM 0 HG3 GLN A 193 -5.719 5.376 -6.621 1.00 0.00 H new ATOM 0 HE21 GLN A 193 -2.361 6.460 -5.892 1.00 0.00 H new ATOM 0 HE22 GLN A 193 -2.541 8.042 -6.658 1.00 0.00 H new ATOM 1041 N LYS A 194 -4.590 4.308 -1.677 1.00 0.00 N ATOM 1042 CA LYS A 194 -4.950 4.176 -0.273 1.00 0.00 C ATOM 1043 C LYS A 194 -3.713 4.440 0.594 1.00 0.00 C ATOM 1044 O LYS A 194 -3.758 5.247 1.520 1.00 0.00 O ATOM 1045 CB LYS A 194 -5.543 2.778 -0.039 1.00 0.00 C ATOM 1046 CG LYS A 194 -6.950 2.641 -0.648 1.00 0.00 C ATOM 1047 CD LYS A 194 -8.066 3.107 0.300 1.00 0.00 C ATOM 1048 CE LYS A 194 -8.706 1.945 1.074 1.00 0.00 C ATOM 1049 NZ LYS A 194 -7.741 1.226 1.923 1.00 0.00 N ATOM 0 H LYS A 194 -4.723 3.447 -2.208 1.00 0.00 H new ATOM 0 HA LYS A 194 -5.707 4.909 0.007 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -4.884 2.027 -0.475 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -5.590 2.578 1.032 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.998 3.221 -1.569 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -7.123 1.599 -0.918 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -7.659 3.829 1.007 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -8.835 3.623 -0.275 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -9.514 2.330 1.696 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -9.153 1.246 0.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -8.253 0.683 2.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -7.179 0.576 1.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -7.108 1.910 2.385 1.00 0.00 H new ATOM 1063 N ALA A 195 -2.595 3.782 0.274 1.00 0.00 N ATOM 1064 CA ALA A 195 -1.329 3.971 0.970 1.00 0.00 C ATOM 1065 C ALA A 195 -0.983 5.463 1.030 1.00 0.00 C ATOM 1066 O ALA A 195 -0.688 6.004 2.097 1.00 0.00 O ATOM 1067 CB ALA A 195 -0.238 3.166 0.256 1.00 0.00 C ATOM 0 H ALA A 195 -2.548 3.099 -0.482 1.00 0.00 H new ATOM 0 HA ALA A 195 -1.407 3.610 1.996 1.00 0.00 H new ATOM 0 HB1 ALA A 195 0.712 3.303 0.772 1.00 0.00 H new ATOM 0 HB2 ALA A 195 -0.504 2.109 0.261 1.00 0.00 H new ATOM 0 HB3 ALA A 195 -0.145 3.512 -0.773 1.00 0.00 H new ATOM 1073 N LEU A 196 -1.046 6.137 -0.120 1.00 0.00 N ATOM 1074 CA LEU A 196 -0.779 7.561 -0.187 1.00 0.00 C ATOM 1075 C LEU A 196 -1.797 8.345 0.645 1.00 0.00 C ATOM 1076 O LEU A 196 -1.416 9.221 1.416 1.00 0.00 O ATOM 1077 CB LEU A 196 -0.764 8.012 -1.652 1.00 0.00 C ATOM 1078 CG LEU A 196 0.408 7.428 -2.464 1.00 0.00 C ATOM 1079 CD1 LEU A 196 0.179 7.721 -3.951 1.00 0.00 C ATOM 1080 CD2 LEU A 196 1.760 8.012 -2.037 1.00 0.00 C ATOM 0 H LEU A 196 -1.281 5.711 -1.016 1.00 0.00 H new ATOM 0 HA LEU A 196 0.202 7.766 0.241 1.00 0.00 H new ATOM 0 HB2 LEU A 196 -1.703 7.720 -2.123 1.00 0.00 H new ATOM 0 HB3 LEU A 196 -0.714 9.100 -1.688 1.00 0.00 H new ATOM 0 HG LEU A 196 0.440 6.354 -2.278 1.00 0.00 H new ATOM 0 HD11 LEU A 196 1.004 7.311 -4.534 1.00 0.00 H new ATOM 0 HD12 LEU A 196 -0.756 7.262 -4.273 1.00 0.00 H new ATOM 0 HD13 LEU A 196 0.126 8.799 -4.106 1.00 0.00 H new ATOM 0 HD21 LEU A 196 2.554 7.569 -2.638 1.00 0.00 H new ATOM 0 HD22 LEU A 196 1.753 9.092 -2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 196 1.936 7.791 -0.984 1.00 0.00 H new ATOM 1092 N ALA A 197 -3.085 8.027 0.508 1.00 0.00 N ATOM 1093 CA ALA A 197 -4.174 8.679 1.227 1.00 0.00 C ATOM 1094 C ALA A 197 -3.939 8.660 2.739 1.00 0.00 C ATOM 1095 O ALA A 197 -4.068 9.697 3.386 1.00 0.00 O ATOM 1096 CB ALA A 197 -5.520 8.047 0.864 1.00 0.00 C ATOM 0 H ALA A 197 -3.405 7.291 -0.122 1.00 0.00 H new ATOM 0 HA ALA A 197 -4.199 9.724 0.918 1.00 0.00 H new ATOM 0 HB1 ALA A 197 -6.317 8.549 1.412 1.00 0.00 H new ATOM 0 HB2 ALA A 197 -5.694 8.152 -0.207 1.00 0.00 H new ATOM 0 HB3 ALA A 197 -5.508 6.990 1.128 1.00 0.00 H new ATOM 1102 N MET A 198 -3.575 7.505 3.310 1.00 0.00 N ATOM 1103 CA MET A 198 -3.287 7.422 4.741 1.00 0.00 C ATOM 1104 C MET A 198 -1.945 8.073 5.109 1.00 0.00 C ATOM 1105 O MET A 198 -1.593 8.121 6.286 1.00 0.00 O ATOM 1106 CB MET A 198 -3.391 5.977 5.253 1.00 0.00 C ATOM 1107 CG MET A 198 -4.852 5.574 5.502 1.00 0.00 C ATOM 1108 SD MET A 198 -5.806 4.961 4.095 1.00 0.00 S ATOM 1109 CE MET A 198 -4.992 3.367 3.882 1.00 0.00 C ATOM 0 H MET A 198 -3.474 6.624 2.806 1.00 0.00 H new ATOM 0 HA MET A 198 -4.055 8.002 5.253 1.00 0.00 H new ATOM 0 HB2 MET A 198 -2.944 5.299 4.526 1.00 0.00 H new ATOM 0 HB3 MET A 198 -2.821 5.875 6.177 1.00 0.00 H new ATOM 0 HG2 MET A 198 -4.861 4.804 6.274 1.00 0.00 H new ATOM 0 HG3 MET A 198 -5.374 6.440 5.909 1.00 0.00 H new ATOM 0 HE1 MET A 198 -4.494 3.339 2.913 1.00 0.00 H new ATOM 0 HE2 MET A 198 -4.255 3.226 4.673 1.00 0.00 H new ATOM 0 HE3 MET A 198 -5.734 2.570 3.931 1.00 0.00 H new ATOM 1119 N GLY A 199 -1.203 8.603 4.135 1.00 0.00 N ATOM 1120 CA GLY A 199 0.031 9.314 4.385 1.00 0.00 C ATOM 1121 C GLY A 199 1.204 8.377 4.616 1.00 0.00 C ATOM 1122 O GLY A 199 2.059 8.679 5.448 1.00 0.00 O ATOM 0 H GLY A 199 -1.452 8.545 3.147 1.00 0.00 H new ATOM 0 HA2 GLY A 199 0.250 9.964 3.538 1.00 0.00 H new ATOM 0 HA3 GLY A 199 -0.094 9.957 5.256 1.00 0.00 H new ATOM 1126 N MET A 200 1.280 7.268 3.867 1.00 0.00 N ATOM 1127 CA MET A 200 2.448 6.398 3.950 1.00 0.00 C ATOM 1128 C MET A 200 3.669 7.244 3.580 1.00 0.00 C ATOM 1129 O MET A 200 3.716 7.831 2.497 1.00 0.00 O ATOM 1130 CB MET A 200 2.311 5.196 3.007 1.00 0.00 C ATOM 1131 CG MET A 200 1.440 4.084 3.599 1.00 0.00 C ATOM 1132 SD MET A 200 2.168 3.291 5.044 1.00 0.00 S ATOM 1133 CE MET A 200 1.064 1.890 5.273 1.00 0.00 C ATOM 0 H MET A 200 0.561 6.962 3.212 1.00 0.00 H new ATOM 0 HA MET A 200 2.550 5.995 4.958 1.00 0.00 H new ATOM 0 HB2 MET A 200 1.880 5.527 2.062 1.00 0.00 H new ATOM 0 HB3 MET A 200 3.301 4.798 2.784 1.00 0.00 H new ATOM 0 HG2 MET A 200 0.470 4.500 3.873 1.00 0.00 H new ATOM 0 HG3 MET A 200 1.258 3.330 2.834 1.00 0.00 H new ATOM 0 HE1 MET A 200 1.348 1.347 6.174 1.00 0.00 H new ATOM 0 HE2 MET A 200 0.039 2.247 5.372 1.00 0.00 H new ATOM 0 HE3 MET A 200 1.135 1.226 4.412 1.00 0.00 H new ATOM 1143 N LYS A 201 4.637 7.353 4.493 1.00 0.00 N ATOM 1144 CA LYS A 201 5.797 8.199 4.310 1.00 0.00 C ATOM 1145 C LYS A 201 6.710 7.658 3.218 1.00 0.00 C ATOM 1146 O LYS A 201 7.669 6.943 3.504 1.00 0.00 O ATOM 1147 CB LYS A 201 6.530 8.385 5.641 1.00 0.00 C ATOM 1148 CG LYS A 201 5.631 8.967 6.740 1.00 0.00 C ATOM 1149 CD LYS A 201 4.999 10.321 6.378 1.00 0.00 C ATOM 1150 CE LYS A 201 4.142 10.864 7.526 1.00 0.00 C ATOM 1151 NZ LYS A 201 3.020 9.960 7.840 1.00 0.00 N ATOM 0 H LYS A 201 4.629 6.851 5.381 1.00 0.00 H new ATOM 0 HA LYS A 201 5.464 9.182 3.975 1.00 0.00 H new ATOM 0 HB2 LYS A 201 6.923 7.424 5.971 1.00 0.00 H new ATOM 0 HB3 LYS A 201 7.385 9.044 5.490 1.00 0.00 H new ATOM 0 HG2 LYS A 201 4.837 8.254 6.961 1.00 0.00 H new ATOM 0 HG3 LYS A 201 6.217 9.083 7.651 1.00 0.00 H new ATOM 0 HD2 LYS A 201 5.784 11.038 6.138 1.00 0.00 H new ATOM 0 HD3 LYS A 201 4.385 10.210 5.485 1.00 0.00 H new ATOM 0 HE2 LYS A 201 4.762 10.997 8.413 1.00 0.00 H new ATOM 0 HE3 LYS A 201 3.754 11.847 7.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 2.251 10.502 8.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 2.674 9.519 6.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 3.343 9.220 8.496 1.00 0.00 H new ATOM 1165 N ARG A 202 6.413 8.033 1.972 1.00 0.00 N ATOM 1166 CA ARG A 202 7.161 7.696 0.769 1.00 0.00 C ATOM 1167 C ARG A 202 8.670 7.736 1.034 1.00 0.00 C ATOM 1168 O ARG A 202 9.402 6.830 0.647 1.00 0.00 O ATOM 1169 CB ARG A 202 6.760 8.688 -0.340 1.00 0.00 C ATOM 1170 CG ARG A 202 7.212 8.200 -1.719 1.00 0.00 C ATOM 1171 CD ARG A 202 6.837 9.176 -2.840 1.00 0.00 C ATOM 1172 NE ARG A 202 7.019 8.544 -4.158 1.00 0.00 N ATOM 1173 CZ ARG A 202 6.080 7.891 -4.861 1.00 0.00 C ATOM 1174 NH1 ARG A 202 4.802 7.868 -4.470 1.00 0.00 N ATOM 1175 NH2 ARG A 202 6.403 7.222 -5.972 1.00 0.00 N ATOM 0 H ARG A 202 5.598 8.612 1.769 1.00 0.00 H new ATOM 0 HA ARG A 202 6.923 6.680 0.454 1.00 0.00 H new ATOM 0 HB2 ARG A 202 5.678 8.821 -0.337 1.00 0.00 H new ATOM 0 HB3 ARG A 202 7.202 9.663 -0.135 1.00 0.00 H new ATOM 0 HG2 ARG A 202 8.292 8.056 -1.714 1.00 0.00 H new ATOM 0 HG3 ARG A 202 6.762 7.228 -1.922 1.00 0.00 H new ATOM 0 HD2 ARG A 202 5.801 9.493 -2.722 1.00 0.00 H new ATOM 0 HD3 ARG A 202 7.454 10.072 -2.772 1.00 0.00 H new ATOM 0 HE ARG A 202 7.947 8.609 -4.576 1.00 0.00 H new ATOM 0 HH11 ARG A 202 4.520 8.354 -3.619 1.00 0.00 H new ATOM 0 HH12 ARG A 202 4.109 7.364 -5.023 1.00 0.00 H new ATOM 0 HH21 ARG A 202 7.371 7.204 -6.293 1.00 0.00 H new ATOM 0 HH22 ARG A 202 5.682 6.729 -6.499 1.00 0.00 H new ATOM 1189 N GLU A 203 9.124 8.775 1.740 1.00 0.00 N ATOM 1190 CA GLU A 203 10.510 8.990 2.114 1.00 0.00 C ATOM 1191 C GLU A 203 11.137 7.728 2.720 1.00 0.00 C ATOM 1192 O GLU A 203 12.243 7.332 2.358 1.00 0.00 O ATOM 1193 CB GLU A 203 10.572 10.144 3.127 1.00 0.00 C ATOM 1194 CG GLU A 203 9.867 11.433 2.670 1.00 0.00 C ATOM 1195 CD GLU A 203 8.440 11.538 3.213 1.00 0.00 C ATOM 1196 OE1 GLU A 203 7.556 10.883 2.619 1.00 0.00 O ATOM 1197 OE2 GLU A 203 8.266 12.242 4.230 1.00 0.00 O ATOM 0 H GLU A 203 8.506 9.514 2.076 1.00 0.00 H new ATOM 0 HA GLU A 203 11.079 9.237 1.218 1.00 0.00 H new ATOM 0 HB2 GLU A 203 10.124 9.813 4.064 1.00 0.00 H new ATOM 0 HB3 GLU A 203 11.617 10.371 3.336 1.00 0.00 H new ATOM 0 HG2 GLU A 203 10.444 12.297 3.001 1.00 0.00 H new ATOM 0 HG3 GLU A 203 9.842 11.464 1.581 1.00 0.00 H new ATOM 1204 N ALA A 204 10.415 7.084 3.642 1.00 0.00 N ATOM 1205 CA ALA A 204 10.881 5.899 4.342 1.00 0.00 C ATOM 1206 C ALA A 204 11.204 4.738 3.399 1.00 0.00 C ATOM 1207 O ALA A 204 12.004 3.881 3.767 1.00 0.00 O ATOM 1208 CB ALA A 204 9.889 5.510 5.439 1.00 0.00 C ATOM 0 H ALA A 204 9.480 7.380 3.921 1.00 0.00 H new ATOM 0 HA ALA A 204 11.830 6.146 4.818 1.00 0.00 H new ATOM 0 HB1 ALA A 204 10.249 4.621 5.956 1.00 0.00 H new ATOM 0 HB2 ALA A 204 9.793 6.330 6.151 1.00 0.00 H new ATOM 0 HB3 ALA A 204 8.917 5.301 4.993 1.00 0.00 H new ATOM 1214 N VAL A 205 10.668 4.705 2.174 1.00 0.00 N ATOM 1215 CA VAL A 205 11.042 3.672 1.209 1.00 0.00 C ATOM 1216 C VAL A 205 12.546 3.737 0.935 1.00 0.00 C ATOM 1217 O VAL A 205 13.199 2.715 0.713 1.00 0.00 O ATOM 1218 CB VAL A 205 10.226 3.840 -0.081 1.00 0.00 C ATOM 1219 CG1 VAL A 205 10.758 2.986 -1.237 1.00 0.00 C ATOM 1220 CG2 VAL A 205 8.760 3.507 0.209 1.00 0.00 C ATOM 0 H VAL A 205 9.980 5.376 1.832 1.00 0.00 H new ATOM 0 HA VAL A 205 10.818 2.688 1.621 1.00 0.00 H new ATOM 0 HB VAL A 205 10.319 4.877 -0.404 1.00 0.00 H new ATOM 0 HG11 VAL A 205 10.142 3.146 -2.122 1.00 0.00 H new ATOM 0 HG12 VAL A 205 11.787 3.270 -1.456 1.00 0.00 H new ATOM 0 HG13 VAL A 205 10.724 1.933 -0.957 1.00 0.00 H new ATOM 0 HG21 VAL A 205 8.173 3.624 -0.702 1.00 0.00 H new ATOM 0 HG22 VAL A 205 8.683 2.478 0.561 1.00 0.00 H new ATOM 0 HG23 VAL A 205 8.378 4.182 0.975 1.00 0.00 H new ATOM 1230 N GLN A 206 13.110 4.943 0.984 1.00 0.00 N ATOM 1231 CA GLN A 206 14.528 5.148 0.771 1.00 0.00 C ATOM 1232 C GLN A 206 15.346 4.724 1.996 1.00 0.00 C ATOM 1233 O GLN A 206 16.567 4.628 1.899 1.00 0.00 O ATOM 1234 CB GLN A 206 14.775 6.596 0.329 1.00 0.00 C ATOM 1235 CG GLN A 206 13.889 6.958 -0.878 1.00 0.00 C ATOM 1236 CD GLN A 206 13.995 5.946 -2.016 1.00 0.00 C ATOM 1237 OE1 GLN A 206 13.013 5.304 -2.374 1.00 0.00 O ATOM 1238 NE2 GLN A 206 15.185 5.766 -2.577 1.00 0.00 N ATOM 0 H GLN A 206 12.591 5.800 1.173 1.00 0.00 H new ATOM 0 HA GLN A 206 14.877 4.503 -0.036 1.00 0.00 H new ATOM 0 HB2 GLN A 206 14.565 7.274 1.156 1.00 0.00 H new ATOM 0 HB3 GLN A 206 15.825 6.727 0.067 1.00 0.00 H new ATOM 0 HG2 GLN A 206 12.851 7.025 -0.553 1.00 0.00 H new ATOM 0 HG3 GLN A 206 14.172 7.944 -1.247 1.00 0.00 H new ATOM 0 HE21 GLN A 206 15.986 6.313 -2.261 1.00 0.00 H new ATOM 0 HE22 GLN A 206 15.298 5.081 -3.324 1.00 0.00 H new ATOM 1247 N GLU A 207 14.690 4.466 3.137 1.00 0.00 N ATOM 1248 CA GLU A 207 15.321 4.013 4.368 1.00 0.00 C ATOM 1249 C GLU A 207 15.190 2.504 4.552 1.00 0.00 C ATOM 1250 O GLU A 207 16.172 1.826 4.849 1.00 0.00 O ATOM 1251 CB GLU A 207 14.785 4.795 5.574 1.00 0.00 C ATOM 1252 CG GLU A 207 15.092 6.297 5.460 1.00 0.00 C ATOM 1253 CD GLU A 207 16.584 6.593 5.295 1.00 0.00 C ATOM 1254 OE1 GLU A 207 17.388 5.896 5.956 1.00 0.00 O ATOM 1255 OE2 GLU A 207 16.895 7.503 4.497 1.00 0.00 O ATOM 0 H GLU A 207 13.679 4.572 3.223 1.00 0.00 H new ATOM 0 HA GLU A 207 16.389 4.219 4.293 1.00 0.00 H new ATOM 0 HB2 GLU A 207 13.708 4.649 5.653 1.00 0.00 H new ATOM 0 HB3 GLU A 207 15.228 4.401 6.489 1.00 0.00 H new ATOM 0 HG2 GLU A 207 14.550 6.709 4.609 1.00 0.00 H new ATOM 0 HG3 GLU A 207 14.723 6.806 6.350 1.00 0.00 H new